SCHEMBL6155133

SCHEMBL6155133

CC(CCCC(C)(C)O)c1cccc(OCc2ccc(COC(C)(C)C(C)(C)C)c(CO[Si](C)(C)C(C)(C)C)c2)c1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 2/20 0.37
CYSLTR1 Q9Y271 2/20 0.37
FFAR1 O14842 4/20 0.34
KDM4E B2RXH2 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
VDR P11473 2/20 0.32
ALOX5 P09917 2/20 0.32
PTGER3 P43115 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6155762 0.87 CYSLTR2 (0.36) CYSLTR2CYSLTR1FFAR1KDM4ERAB9A
SCHEMBL6154985 0.80 PTGER3 (0.35) CYSLTR2CYSLTR1FFAR1ALOX5PTGER3
SCHEMBL6155571 0.79 VDR (0.46) CYSLTR2CYSLTR1FFAR1VDRALOX5
SCHEMBL6158470 0.79 NOS1 (0.38) CYSLTR2CYSLTR1FFAR1VDR
SCHEMBL6155136 0.79 FFAR1 (0.38) CYSLTR2CYSLTR1FFAR1
SCHEMBL6155131 0.78 CYSLTR2 (0.36) CYSLTR2CYSLTR1FFAR1KDM4ERAB9A
SCHEMBL6155407 0.78 CYSLTR2 (0.49) CYSLTR2CYSLTR1FFAR1PTGER3
SCHEMBL2109172 0.78 VDR (0.41) CYSLTR2CYSLTR1FFAR1VDR
SCHEMBL6155242 0.77 VDR (0.44) CYSLTR2CYSLTR1FFAR1VDR
SCHEMBL6878849 0.75 CYSLTR2 (0.39) CYSLTR2CYSLTR1FFAR1PTGER3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1124779-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2005-02-02 EP disclosed
US-6689922-B1 BIAROMATIC COMPOUNDS WHICH ARE ANALOGUES OF VITAMIN D HAVE A MARKED ACTIVITY IN THE FIELDS OF CELL DIFFERENTIATION AND PROLIFERATION GALDERMA RESEARCH & DEVELOPMENT S.N.C. (FR) 2004-02-10 US disclosed
EP-1124779-A1 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2001-08-22 EP disclosed
WO-2000026167-A1 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2000-05-11 WO disclosed